Brief Information of the Compound and Protein
Compound Name
(2S)-5-carbamimidamido-2-[[(2R)-2-[[(2S)-2-[[2-[2-[3-[2-[2-[3-[[(2S)-2-[[(2S)-5-carbamimidamido-1-hydroxy-2-[[(2R)-1-hydroxy-2-[[(2S)-1-hydroxy-2-(1-hydroxyethylideneamino)-3-(1H-imidazol-5-yl)propylidene]amino]-3-phenylpropylidene]amino]pentylidene]amino]-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino]propoxy]ethoxy]ethoxy]propylimino]-2-hydroxyethoxy]-1-hydroxyethylidene]amino]-1-hydroxy-3-(1H-imidazol-5-yl)propylidene]amino]-1-hydroxy-3-phenylpropylidene]amino]-N-[(2S)-1-hydroxy-1-imino-3-(1H-indol-3-yl)propan-2-yl]pentanimidic acid
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PubChem ID
CID: 127047475
Canonical SMILES
CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCCOCCOCCOCCCNC(=O)COCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O
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Compound Formula C80H107N23O15
Compound Structure
Protein Name
Melanocortin receptor 4
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Short peptide receptor (family A GPCR)
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Melanocortin receptor
Uniprot ID
P56450
Gene Name
MC4R
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  2
1
EC50 = 3.6 nM
   TI
   LI
   LO
   TS
2
IC50 = 9.9 nM
   TI
   LI
   LO
   TS